N-[(2R)-1-azanyl-6-[[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]amino]-1-oxidanylidene-hexan-2-yl]-4-methylsulfanyl-benzamide

Systemtic Name: N-[(2R)-1-azanyl-6-[[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]amino]-1-oxidanylidene-hexan-2-yl]-4-methylsulfanyl-benzamide Openeye Name: N-[(1R)-5-[[4-(4-tert-butylphenyl)thiazol-2-yl]amino]-1-carbamoyl-pentyl]-4-methylsulfanyl-benzamide CAS Name: N-[(2R)-1-amino-6-[[4-(4-tert-butylphenyl)-2-thiazolyl]amino]-1-oxohexan-2-yl]-4-(methylthio)benzamide IUPAC Name: N-[(2R)-1-amino-6-[[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]amino]-1-oxohexan-2-yl]-4-methylsulfanylbenzamide Traditional Name: N-[(1R)-5-[[4-(4-tert-butylphenyl)thiazol-2-yl]amino]-1-carbamoyl-pentyl]-4-(methylthio)benzamide Formula: C27H34N4O2S2 MolecularWeight: 510.71446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CSC(=N2)NCCCCC(C(=O)N)NC(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CSC(=N2)NCCCC[C@H](C(=O)N)NC(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C27H34N4O2S2/c1-27(2,3)20-12-8-18(9-13-20)23-17-35-26(31-23)29-16-6-5-7-22(24(28)32)30-25(33)19-10-14-21(34-4)15-11-19/h8-15,17,22H,5-7,16H2,1-4H3,(H2,28,32)(H,29,31)(H,30,33)/t22-/m1/s1